Home Other Building Blocks (3S)-3-ethyl-1,4-diazepan-2-one

(3S)-3-ethyl-1,4-diazepan-2-one

CAS No.:
2090219-08-0
Catalog Number:
AG01BS63
Molecular Formula:
C7H14N2O
Molecular Weight:
142.1989
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BS63
Chemical Name:
(3S)-3-ethyl-1,4-diazepan-2-one
CAS Number:
2090219-08-0
Molecular Formula:
C7H14N2O
Molecular Weight:
142.1989
MDL Number:
MFCD31421176
IUPAC Name:
3-ethyl-1,4-diazepan-2-one
InChI:
InChI=1S/C7H14N2O/c1-2-6-7(10)9-5-3-4-8-6/h6,8H,2-5H2,1H3,(H,9,10)
InChI Key:
SGCXXMVKFMVWMF-UHFFFAOYSA-N
SMILES:
CC[C@@H]1NCCCNC1=O
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.111g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
142.202g/mol
Monoisotopic Mass:
142.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties